IFLAB-ZINC04504796 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 43 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4120 -0.5260 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8620 -1.3210 -1.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1570 -1.8000 -1.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0070 -1.4830 0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5530 -0.6850 1.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2550 -0.2130 1.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2820 -1.9530 0.0420 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.1010 -1.5860 1.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4700 -2.1950 0.9930 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7200 -2.8760 0.0210 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.4160 -1.9830 1.9290 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.7470 -2.5740 1.7720 C 0 0 3 0 0 0 0 0 0 0 0 0 -10.0130 -2.6020 0.7150 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7810 -1.7350 2.5430 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.0770 -2.5820 2.6130 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.4390 -4.2570 2.9950 S 0 0 0 0 0 0 0 0 0 0 0 0 -12.1170 -5.2140 2.1920 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.3810 -4.4290 4.4040 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.7500 -4.0050 2.3450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -0.1590 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7570 -1.6010 1.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7650 -0.1340 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -1.5670 -1.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5090 -2.4210 -1.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2130 -0.4370 1.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9000 0.4050 1.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6470 -1.9520 2.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1880 -0.5010 1.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2160 -1.4380 2.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4160 -1.5260 3.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9730 -0.8010 2.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.7300 -2.2260 3.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.5960 -2.5750 1.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5370 -4.7280 1.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0180 -4.0920 3.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 26 1 0 0 0 0 3 27 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 22 1 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 17 38 1 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 18 40 1 0 0 0 0 19 20 2 0 0 0 0 19 21 2 0 0 0 0 19 22 1 0 0 0 0 22 41 1 0 0 0 0 22 42 1 0 0 0 0 M END